[(3R)-1-(isoquinolin-5-ylmethyl)-3-[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3R)-1-(isoquinolin-5-ylmethyl)-3-[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3R)-1-(5-isoquinolylmethyl)-3-(o-tolylmethyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3R)-1-(5-isoquinolinylmethyl)-3-[(2-methylphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3R)-1-(isoquinolin-5-ylmethyl)-3-[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3R)-1-(5-isoquinolylmethyl)-3-(2-methylbenzyl)piperidin-1-ium-3-yl]methanol Formula: C24H29N2O+ MolecularWeight: 361.49986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2(CCC[NH+](C2)CC3=CC=CC4=C3C=CN=C4)CO

Isomeric SMILES

CC1=CC=CC=C1C[C@@]2(CCC[NH+](C2)CC3=CC=CC4=C3C=CN=C4)CO

InChI

InChI=1S/C24H28N2O/c1-19-6-2-3-7-20(19)14-24(18-27)11-5-13-26(17-24)16-22-9-4-8-21-15-25-12-10-23(21)22/h2-4,6-10,12,15,27H,5,11,13-14,16-18H2,1H3/p+1/t24-/m1/s1